methyl 2-[1-[2-[di(propan-2-yl)amino]-2-oxidanylidene-ethyl]benzimidazol-2-yl]sulfanylethanoate

Systemtic Name: methyl 2-[1-[2-[di(propan-2-yl)amino]-2-oxidanylidene-ethyl]benzimidazol-2-yl]sulfanylethanoate Openeye Name: methyl 2-[1-[2-(diisopropylamino)-2-oxo-ethyl]benzimidazol-2-yl]sulfanylacetate CAS Name: 2-[[1-[2-[di(propan-2-yl)amino]-2-oxoethyl]-2-benzimidazolyl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[1-[2-[di(propan-2-yl)amino]-2-oxoethyl]benzimidazol-2-yl]sulfanylacetate Traditional Name: 2-[[1-[2-(diisopropylamino)-2-keto-ethyl]benzimidazol-2-yl]thio]acetic acid methyl ester Formula: C18H25N3O3S MolecularWeight: 363.4744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C(C)C)C(=O)CN1C2=CC=CC=C2N=C1SCC(=O)OC

Isomeric SMILES

CC(C)N(C(C)C)C(=O)CN1C2=CC=CC=C2N=C1SCC(=O)OC

InChI

InChI=1S/C18H25N3O3S/c1-12(2)21(13(3)4)16(22)10-20-15-9-7-6-8-14(15)19-18(20)25-11-17(23)24-5/h6-9,12-13H,10-11H2,1-5H3